SCHEMBL8255448

SCHEMBL8255448

CC(C)N1CCC(N2CCCCCC2)CC1

nearest known ligand 0.48

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
L3MBTL3 Q96JM7 7/20 0.47
L3MBTL1 Q9Y468 5/20 0.47
MBTD1 Q05BQ5 5/20 0.45
HRH3 Q9Y5N1 3/20 0.42
CYP2C19 P33261 2/20 0.39
CYP2D6 P10635 1/20 0.39
KDM4E B2RXH2 1/20 0.38
ALDH1A1 P00352 1/20 0.38
CYP3A4 P08684 1/20 0.37

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL278657 1.00 L3MBTL3 (0.47) L3MBTL3L3MBTL1MBTD1HRH3CYP2C19
SCHEMBL8263855 1.00 L3MBTL3 (0.47) L3MBTL3L3MBTL1MBTD1HRH3CYP2C19
SCHEMBL8259607 0.98 L3MBTL3 (0.46) L3MBTL3L3MBTL1MBTD1HRH3CYP2C19
SCHEMBL3439846 0.98 L3MBTL3 (0.48) L3MBTL3L3MBTL1MBTD1HRH3CYP2C19
SCHEMBL10162401 0.93 L3MBTL3 (0.44) L3MBTL3L3MBTL1MBTD1HRH3
SCHEMBL25050072 0.91 L3MBTL3 (0.44) L3MBTL3L3MBTL1MBTD1HRH3
SCHEMBL10162384 0.90 HRH3 (0.46) L3MBTL3L3MBTL1MBTD1HRH3
SCHEMBL22456360 0.89 L3MBTL3 (0.42) L3MBTL3L3MBTL1MBTD1HRH3CYP2C19
SCHEMBL24870608 0.89 HRH3 (0.44) L3MBTL3L3MBTL1MBTD1HRH3
SCHEMBL10162381 0.87 HRH3 (0.43) L3MBTL3L3MBTL1MBTD1HRH3

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 12 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210147385-A1 COMPOUNDS AND METHODS FOR TARGETING PATHOGENIC BLOOD VESSELS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2021-05-20 US disclosed
US-8741899-B2 (4-chloro-2-fluoro-N-(2-fluorophenyl)-5-[(8aR)-hexahydropyrrolo-[1,2-a]pyrazin-2(1H)-ylcarbonyl]-benzenesulfonamide, and pharmaceutically acceptable salts thereof ABBVIE INC. (US) 2014-06-03 US disclosed
US-20130210827-A1 NOVEL BENZENESULFONAMIDES AS CALCIUM CHANNEL BLOCKERS ABBVIE INC. (US) 2013-08-15 US disclosed
US-8404719-B2 Substituted piperidinylcarbonylbenzenesulfonamides as calcium channel blockers ABBVIE INC. (US) 2013-03-26 US disclosed
US-20120083499-A1 NOVEL BENZENESULFONAMIDES AS CALCIUM CHANNEL BLOCKERS ABBOTT LABORATORIES (US) 2012-04-05 US disclosed
US-8101614-B2 Substituted pyrrolo [1,2-a] pyrazines as calcium channel blockers ABBOTT LABORATORIES (US) 2012-01-24 US disclosed
US-20100197693-A1 NOVEL BENZENESULFONAMIDES AS CALCIUM CHANNEL BLOCKERS ABBOTT LABORATORIES (US) 2010-08-05 US disclosed
US-7256186-B2 Gamma secretase inhibitors SCHERING CORPORATION (US) 2007-08-14 US disclosed
US-7208602-B2 Gamma secretase inhibitors SCHERING CORPORATION (US) 2007-04-24 US disclosed
US-20050085506-A1 Novel gamma secretase inhibitors SCHERING-PLOUGH CORPORATION AND PHARMACOPEIA, INC. 2005-04-21 US disclosed
US-20040171614-A1 Novel gamma secretase inhibitors SCHERING-PLOUGH CORPORATION 2004-09-02 US disclosed
US-20040171614-A1 Novel gamma secretase inhibitors SCHERING-PLOUGH CORPORATION 2004-09-02 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (6 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20040171614-A1 Novel gamma secretase inhibitors BACE1, BACE2, APP L3MBTL3 3906/4885L3MBTL1 4015/4885MBTD1 4148/4885
US-20130210827-A1 NOVEL BENZENESULFONAMIDES AS CALCIUM CHANNEL BLOCKERS CACNA1E, RYR2, RYR1 L3MBTL3 2063/4885L3MBTL1 1498/4885MBTD1 945/4885
US-20120083499-A1 NOVEL BENZENESULFONAMIDES AS CALCIUM CHANNEL BLOCKERS CACNA1E, RYR2, RYR1 L3MBTL3 2063/4885L3MBTL1 1498/4885MBTD1 945/4885
US-20050085506-A1 Novel gamma secretase inhibitors BACE1, BACE2, APP L3MBTL3 2301/4885L3MBTL1 2500/4885MBTD1 3916/4885
US-20210147385-A1 COMPOUNDS AND METHODS FOR TARGETING PATHOGENIC BLOOD VESSELS TEK, KDR, LIPG L3MBTL3 3188/4885L3MBTL1 2745/4885MBTD1 1747/4885
US-20100197693-A1 NOVEL BENZENESULFONAMIDES AS CALCIUM CHANNEL BLOCKERS CACNA1E, RYR2, RYR1 L3MBTL3 2063/4885L3MBTL1 1498/4885MBTD1 945/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.